الاسم: 2-(3-methylaminopropoxy)thioxanthen-9-one
SMILES:
CNCCCOc1ccc2sc3ccccc3c(=O)c2c1Molecular Processing
Molecular formula
C17H17NO2S
Molecular weight
299.4
Exact mass
299.098
XLogP
3.4
TPSA
38.33
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
21
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.235
Molar refractivity
89.64
Supplementary Information
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